NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.2489 0.0000 0.0000 61.8906 32.5965 174.2721 3 K 3.4707 8.6938 119.5249 56.1892 31.7543 174.7539 4 M 3.9688 9.4183 127.3878 56.2120 33.4718 174.9615 5 K 4.5788 8.2986 124.2061 54.8093 34.1569 176.4560 6 T 4.3044 8.1380 112.5343 61.6352 69.8419 174.9023 7 H 4.4239 8.6007 124.3191 54.6660 28.7430 175.5862 8 K 3.9950 8.6195 125.2233 59.3093 31.6185 178.0200 9 G 3.8487 8.1939 104.8162 48.1802 0.0000 175.2493 10 A 3.8651 8.4721 122.9479 54.5280 18.2373 179.6168 11 K 4.0268 8.0395 116.8632 59.2405 32.3937 178.6718 12 K 4.2788 7.8797 117.9502 57.9228 32.0396 177.7556 13 R 4.6261 7.2396 112.7652 55.2924 29.9157 174.6139 14 V 4.5980 7.4925 116.9720 60.9014 35.5052 174.7574 15 K 4.2412 8.1226 118.7651 55.5687 35.2138 174.2606 16 I 4.4204 8.5693 129.5614 61.2979 38.6319 175.2251 17 T 4.5074 9.2889 120.1846 60.1854 71.0827 175.6497 18 A 4.1637 8.7238 125.8178 55.7245 18.3706 179.3422 19 S 4.2307 7.8395 106.7433 59.2480 63.3638 174.5872 20 G 3.8582 9.0001 110.7580 45.6961 0.0000 173.6777 21 K 4.5458 7.7689 117.7764 54.8695 34.6460 175.7391 22 V 4.6551 8.2356 121.2931 61.2840 34.4541 174.5576 23 V 4.8859 8.6817 126.3544 61.4148 34.7770 174.0165 24 A 4.9000 8.5192 128.7508 50.1432 22.6810 175.0367 25 M 4.4835 8.4262 120.4439 55.4283 32.3146 176.9689 26 K 4.4613 8.4134 124.0874 55.2888 34.7486 176.0901 27 T 3.9149 8.7876 115.0620 60.7128 69.8890 171.9287 28 G 4.2430 9.9969 120.0272 45.1494 0.0000 175.2035 29 K 4.8966 7.8389 114.3154 54.3979 37.0896 177.0684 30 R 3.5884 8.2357 117.8744 57.7071 28.6387 171.5980 31 H 4.5069 8.0292 129.2301 54.7038 27.9359 174.4993 32 L 4.7540 7.6662 117.1928 54.5044 42.3553 178.6943 33 N 4.2808 8.9237 118.6757 56.1570 38.1805 179.4722 34 W 3.8571 7.1036 123.3100 57.9575 33.2553 176.1511 35 Q 4.0093 6.9219 123.3533 54.6810 30.0821 173.8742 36 K 4.4683 7.7254 120.6015 53.5395 35.1113 176.5696 37 S 4.2370 8.2823 115.3505 58.2807 63.6096 175.7685 38 G 3.5082 8.4772 109.5444 48.3603 0.0000 175.6662 39 K 3.9939 7.3837 119.6879 58.0330 31.7963 176.9676 40 E 4.1782 7.5188 119.8762 57.3372 29.1595 177.1917 41 I 3.5900 7.7434 117.0334 64.5435 38.0073 177.7510 42 R 4.0799 7.8864 119.7767 58.9673 29.6283 177.7946 43 Q 4.3804 8.4545 117.8697 56.4516 28.7376 176.6305 44 K 4.5092 7.9293 116.2122 53.9296 31.5080 175.3456 45 G 4.3677 7.4912 109.7651 43.5308 0.0000 171.0297 46 R 4.4431 8.6369 117.8139 57.2674 31.0522 175.8525 47 K 4.7019 7.6368 120.2072 57.7256 33.4514 172.8712 48 F 5.6371 7.8984 113.8568 53.8073 39.8547 175.2868 49 V 3.9291 8.5842 117.0656 61.7100 32.8845 174.9345 50 L 4.3399 8.5468 120.3785 54.9805 45.2020 174.4255 51 A 3.9452 8.8225 126.0184 52.7600 16.2023 178.2540 52 K 4.5105 7.7842 112.8263 57.1855 35.0267 174.8624 53 P 4.9759 0.0000 0.0000 62.8331 32.6389 176.4884 54 E 3.9641 8.3087 118.3626 59.5652 29.0458 178.8394 55 A 3.9911 7.9277 119.0424 55.5461 18.7012 178.9780 56 E 3.9918 8.2479 116.4402 59.7413 29.3887 179.8571 57 R 3.9557 8.5817 118.1761 59.6328 29.9987 178.9780 58 I 3.7179 7.5616 118.5177 63.8270 37.5802 177.8925 59 K 4.3100 9.2632 119.1395 57.1512 30.9253 177.4178 60 L 5.0645 7.4239 120.1156 53.2301 42.6084 176.2260 61 L 4.5372 7.5183 119.5996 55.8707 42.1839 175.5061 62 L 4.0972 9.2206 127.2926 55.0313 38.1920 173.4498 63 P 4.3226 0.0000 0.0000 65.1564 32.5727 177.8019 64 Y 3.8512 8.0251 115.7867 58.4064 36.3012 169.6601 65 E 4.5323 9.0337 127.7349 58.0943 29.0087 175.3199 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 P 0.00 4.25 0.00 2.19 2.17 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.96 0.00 3 K 8.69 3.47 0.00 1.80 1.82 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.47 7.81 4 M 9.42 3.97 0.00 2.01 1.98 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.60 0.00 5 K 8.30 4.58 0.00 1.77 1.70 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.36 1.40 7.81 6 T 8.14 4.30 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 7 H 8.60 4.42 0.00 3.25 3.26 0.00 5.63 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.62 4.00 0.00 1.76 1.88 0.00 1.76 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.49 7.81 9 G 8.19 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 A 8.47 3.87 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 K 8.04 4.03 0.00 1.79 2.01 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.55 7.81 12 K 7.88 4.28 0.00 2.02 1.87 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.59 7.81 13 R 7.24 4.63 0.00 1.75 1.97 0.00 3.02 0.00 0.00 3.29 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.53 0.00 14 V 7.49 4.60 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.95 0.00 0.00 15 K 8.12 4.24 0.00 1.92 1.68 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.50 7.81 16 I 8.57 4.42 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.93 0.97 0.00 0.00 17 T 9.29 4.51 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 18 A 8.72 4.16 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 S 7.84 4.23 0.00 3.95 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 9.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 K 7.77 4.55 0.00 1.66 1.72 0.00 1.27 0.00 0.00 1.43 0.00 0.00 2.79 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.40 1.31 7.81 22 V 8.24 4.66 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.95 0.00 0.00 23 V 8.68 4.89 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.91 0.00 0.00 24 A 8.52 4.90 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 M 8.43 4.48 0.00 2.04 1.97 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.52 0.00 26 K 8.41 4.46 0.00 1.70 1.71 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.50 7.81 27 T 8.79 3.91 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 28 G 10.00 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.84 4.90 0.00 1.77 1.02 0.00 1.71 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.41 1.55 7.81 30 R 8.24 3.59 0.00 1.82 1.86 0.00 3.35 0.00 0.00 3.18 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.77 0.00 31 H 8.03 4.51 0.00 3.22 3.45 0.00 5.78 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.67 4.75 0.00 1.77 1.72 0.90 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 33 N 8.92 4.28 0.00 2.79 2.90 0.00 0.00 6.72 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 W 7.10 3.86 0.00 3.31 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 Q 6.92 4.01 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.59 0.00 0.00 0.00 0.00 0.00 1.82 1.87 0.00 36 K 7.73 4.47 0.00 1.69 1.65 0.00 1.72 0.00 0.00 1.76 0.00 0.00 2.88 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.37 1.32 7.81 37 S 8.28 4.24 0.00 3.95 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 8.48 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 K 7.38 3.99 0.00 1.58 1.83 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.51 7.81 40 E 7.52 4.18 0.00 2.16 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 41 I 7.74 3.59 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.69 0.95 0.00 0.00 42 R 7.89 4.08 0.00 2.03 1.99 0.00 3.08 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 43 Q 8.45 4.38 0.00 2.25 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.97 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 44 K 7.93 4.51 0.00 1.91 1.73 0.00 1.65 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.39 7.81 45 G 7.49 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 R 8.64 4.44 0.00 1.85 1.98 0.00 3.42 0.00 0.00 3.94 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.60 0.00 47 K 7.64 4.70 0.00 2.08 2.04 0.00 1.31 0.00 0.00 1.82 0.00 0.00 3.04 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.38 1.43 7.81 48 F 7.90 5.64 0.00 3.08 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 V 8.58 3.93 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 1.02 0.00 0.00 50 L 8.55 4.34 0.00 1.72 1.41 0.96 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.82 3.95 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 7.78 4.51 0.00 1.73 1.90 0.00 1.65 0.00 0.00 1.75 0.00 0.00 3.16 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.42 7.81 53 P 0.00 4.98 0.00 2.30 2.28 0.00 3.91 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.91 0.00 54 E 8.31 3.96 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 55 A 7.93 3.99 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 E 8.25 3.99 0.00 2.23 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 57 R 8.58 3.96 0.00 1.99 2.00 0.00 3.11 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.74 0.00 58 I 7.56 3.72 2.15 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.75 0.93 0.00 0.00 59 K 9.26 4.31 0.00 1.64 1.88 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.69 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.62 7.81 60 L 7.42 5.06 0.00 1.78 1.70 0.95 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 61 L 7.52 4.54 0.00 1.69 1.67 1.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 62 L 9.22 4.10 0.00 1.68 1.95 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 63 P 0.00 4.32 0.00 2.21 2.13 0.00 4.01 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 64 Y 8.03 3.85 0.00 3.10 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 E 9.03 4.53 0.00 1.99 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.20 0.00